T579-1814 Screening compound: 1-(cyclopropylmethyl)-5-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-1,2-dihydropyridin-2-one

T579-1814 Screening compound: 1-(cyclopropylmethyl)-5-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-1,2-dihydropyridin-2-one
T579-1814 Screening compound: 1-(cyclopropylmethyl)-5-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-1,2-dihydropyridin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T579-1814
1-(cyclopropylmethyl)-5-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-1,2-dihydropyridin-2-one

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

T579-1814

Molecular Formula

C19H23N3O2S (C19 H23 N3 O2 S)

Compound Name

1-(cyclopropylmethyl)-5-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-1,2-dihydropyridin-2-one

IUPAC name

1-(cyclopropylmethyl)-5-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-12-dihydropyridin-2-one

SMILES

O=C(c1cccs1)N1CCN(CC(C=C2)=CN(CC3CC3)C2=O)CC1

InChI

InChI=1S/C19H23N3O2S/c23-18-6-5-16(14-22(18)13-15-3-4-15)12-20-7-9-21(10-8-20)19(24)17-2-1-11-25-17/h1-2,5-6,11,14-15H,3-4,7-10,12-13H2

InChI Key

YLXGKEWJYHSMDI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29027828

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.588

Distribution Coefficient, logD

1.553

Water Solubility, LogSw

-2.21

Polar Surface Area

38.480

Acid Dissociation Constant (pKa)

25.60

Base Dissociation Constant (pKb)

6.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.40

T579-1814 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with T579-1814 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T579-1814?
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What is the minimum amount of T579-1814 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T579-1814
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T579-1814
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of T579-1814 available by request